SCHEMBL21387486

SCHEMBL21387486

Fc1cccc(OCC2CCC(P)CC2)c1F

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
KCNN4 O15554 1/20 0.40
METAP2 P50579 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
HTR2C P28335 4/20 0.38
HTR2A P28223 2/20 0.38
HTR2B P41595 2/20 0.38
MCHR1 Q99705 2/20 0.37
DCPS Q96C86 2/20 0.36
HTR1A P08908 1/20 0.36
CYP2D6 P10635 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21387534 0.96 RIPK1 (0.38) RIPK1SLC6A2SLC6A4SLC6A3KCNN4
SCHEMBL15969381 0.92 RIPK1 (0.46) RIPK1SLC6A2SLC6A4SLC6A3KCNN4
SCHEMBL23074226 0.84 RIPK1 (0.41) RIPK1SLC6A2SLC6A4SLC6A3KCNN4
SCHEMBL21575503 0.84 TLR9 (0.42) RIPK1SLC6A2SLC6A4SLC6A3KCNN4
SCHEMBL2261643 0.84 RIPK1 (0.44) RIPK1SLC6A2SLC6A4SLC6A3KCNN4
SCHEMBL10091219 0.84 RIPK1 (0.44) RIPK1SLC6A2SLC6A4SLC6A3KCNN4
SCHEMBL2261640 0.84 RIPK1 (0.44) RIPK1SLC6A2SLC6A4SLC6A3KCNN4
SCHEMBL18466652 0.84 MCHR1 (0.50) SLC6A2SLC6A4SLC6A3KCNN4METAP2
SCHEMBL28673516 0.83 KCNN4 (0.42) RIPK1SLC6A2SLC6A4SLC6A3KCNN4
SCHEMBL9561997 0.82 RIPK1 (0.46) RIPK1SLC6A2SLC6A4SLC6A3KCNN4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3061802-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2019-09-25 EP disclosed